5,6-bis(iodanyl)-2,3,7-trimethyl-benzo[7]annulen-9-one

Systemtic Name: 5,6-bis(iodanyl)-2,3,7-trimethyl-benzo[7]annulen-9-one Openeye Name: 5,6-diiodo-2,3,7-trimethyl-benzo[7]annulen-9-one CAS Name: 5,6-diiodo-2,3,7-trimethyl-9-benzo[7]annulenone IUPAC Name: 5,6-diiodo-2,3,7-trimethylbenzo[7]annulen-9-one Traditional Name: 5,6-diiodo-2,3,7-trimethyl-benzocyclohepten-9-one Formula: C14H12I2O MolecularWeight: 450.05342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C2=CC(=C(C=C2C(=C1I)I)C)C

Isomeric SMILES

CC1=CC(=O)C2=CC(=C(C=C2C(=C1I)I)C)C

InChI

InChI=1S/C14H12I2O/c1-7-4-10-11(5-8(7)2)14(16)13(15)9(3)6-12(10)17/h4-6H,1-3H3